PUBCHEM-ZINC02047304 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 -0.3340 1.4630 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 0.0830 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6370 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 0.0060 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.3840 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.1040 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 3.8590 0.3190 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 4.0930 -0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 4.3350 -0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 4.4530 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 5.9700 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 6.4270 3.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 6.8000 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 6.8100 3.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 7.1500 5.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 6.9720 5.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 6.5340 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 6.2760 4.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 7.2190 6.8170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7610 7.7450 6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 8.0380 7.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 8.2060 7.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 7.6170 6.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 5.8820 7.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 4.8230 7.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 5.9930 8.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 4.8710 9.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 5.1000 10.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 4.1360 11.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 2.7030 10.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 2.6520 10.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 3.5630 8.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 4.9990 9.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 1.2490 9.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 0.7440 10.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5780 1.2890 10.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -0.2020 9.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -2.5060 1.1190 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 2.0160 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.4190 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -0.5570 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 1.8810 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 4.0760 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 4.0240 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 6.3550 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 6.3860 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 8.4960 8.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 8.7910 8.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 6.7770 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 8.3650 5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 6.8830 8.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 3.9570 8.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 4.7670 10.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 6.1190 10.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 4.1460 11.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 4.5000 12.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 2.2710 10.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 2.0870 11.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 3.0490 10.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 3.1760 8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 3.5620 8.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 5.4260 9.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 5.6080 8.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 0.5580 8.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 0.9600 8.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -0.3950 8.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 2 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 M CHG 1 35 1 M END